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Ligand

NameCHEMBL1259043
Molecular formulaC25H26N2S
IUPAC name1-methyl-4-(3-phenyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
Molecular weight386.557
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.3
SynonymsBDBM50328489
1-Methyl-4-(8-phenyl-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-piperazine
Inchi KeyMHGTXXJLRSTLOC-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26N2S/c1-26-13-15-27(16-14-26)23-18-21-9-5-6-10-24(21)28-25-12-11-20(17-22(23)25)19-7-3-2-4-8-19/h2-12,17,23H,13-16,18H2,1H3
PubChem CID49781453
ChEMBLCHEMBL1259043
IUPHARN/A
BindingDB50328489
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
205416Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
205415Alpha-1B adrenergic receptorP18841ADRA1BMesocricetus auratus (Golden hamster)515
205413Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561
205414D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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